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11 research outputs found
Can Excited Electronic States of Macromolecules with Extended Pi-Systems be Reliably Predicted? A Case Study on P3HT
Author
Gromacs
Publication venue
'Frontiers Media SA'
Publication date
Field of study
No full text
Crossref
A method to obtain a near-minimal-volume molecular simulation of a macromolecule, using periodic boundary conditions and rotational constraints
Author
Amadei
Bekker
+9 more
Berman
Betke
Computational Geometry Algorithms Library
de Berg
Edelsbrunner
Eisenhaber
Gottschalk
GROMACS
T�th
Publication venue
'Wiley'
Publication date
01/01/2004
Field of study
No full text
Crossref
Effect of nanoparticle concentration on coagulation rate of colloidal suspensions
Author
Atmuri
Babichev
+38 more
Boltachev
Boltachev
Boltachev
Botet
Cametti
Chandrasekhar
Corni
Deryaguin
Dor
Dukhin
Fuchs
Gilbert
GROMACS Documentation. Release
Hamaker
Hogg
Ivanov
Ivanov
Ivanov
Kolb
Koroleva
Koroleva
Koroleva
Kramers
Landau
McGown
Metin
Peng
Prieve
Puzyrev
Radice
Rami
Schneider
Smoluchowski
Turchenkov
Urbina-Villalba
Van Der Spoel
Videcoqa
Zimon
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Atypical Dependence of Electroosmotic Transport on Surface Charge in a Single-wall Carbon Nanotube
Author
Barrat J. L.
Berendsen H. J. C.
+18 more
Berendsen H. J. C.
Darden T.
Gromacs User Manual 0.
Hess B.
Israelachvili J.
Kemery P. J.
Kuo T. C.
Lindahl E.
Lyubartsev A. P.
Mao Z.
Miller S. A.
Qiao R.
Sokhan V.
Sokhan V.
Spohr E.
Sun L.
Werder T.
Zhu Y.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
Morphology and dynamics of domains in ergosterol or cholesterol containing membranes
Author
Adhyapak
Alberts
+116 more
Albrecht
Allende
Andreoli
Aresta-Branco
Armando Antillón
Arturo Galván-Hernández
Asakawa
Bagiński
Baran
Beattie
Bolton
Bowie
Braet
Braet
Brian
Brown
Brown
Brown
Brown
Bukiya
Cinek
Cotero
Cournia
Cross
Cuenca-Estrella
Czub
de Almeida
de Almeida
de Kruijff
Domanov
Dos Santos
El Kirat
Ferber
Fernandez
Fichtenbaum
Fidorra
Finkelstein
Frisch
Frisz
Fukuma
García-Arribas
Goh
González-Damián
Gray
Grimme
GROMACS
GROMACS
Halgren
Hamill
Henriksen
Heyse
Higgins
Ho
Hong
Hong
Hsueh
Huang
Hung
Iván Ortega-Blake
Iyer
Jena
Jorge Hernández-Cobos
Jämbeck
Jämbeck
Jämbeck
Kinoshita
Klauda
Kontoyiannis
Kraft
Krauss
Laney
Lawrence
Lekka
Lekka
Lichtenberg
Lindahl
Lorent
Marenich
Maté
McConnell
Mihailescu
Mou
Murthy
Naritaka Kobayashi
Odds
Ollila
Ovalle-García
Patra
Peerboom
Pencer
Pettersen
Powderly
Pronk
Rafts
Rinia
Róg
Samuli Ollila
Sankaram
Schaftenaar
Seiichiro Nakabayashi
Simons
Structural diversity of sphingomyelin microdomains
Tang
Taylor
Turner
Urbina
van Duyl
Vanegas
Vanegas
Venable
Venegas
Vinckier
Xu
Xu
Yeager
Yuan
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
The C-type lectin-like receptor Nkrp1b: Structural proteomics reveals features affecting protein conformation and interactions
Author
Aguilar
Aguilar
+69 more
Alan Kádek
Back
Benesch
Berry
Boes
Bush
Campbell
Carlyle
Chambers
Chen
Drickamer
Eswar
Feinberg
Fine
Goss
Gromacs
Han
Hernychová
Hernández
Hirotsu
Iizuka
Jan Černý
Josef Chmelík
Karasuyama
Kolenko
Kristián Skála
Kufareva
Kung
Kveberg
Kärre
Lanier
Li
Li
Ljubina Adámková
Lucie Hernychová
Marklund
Michal Rosůlek
Ondřej Šebesta
Petr Novák
Pompach
Robetta: full-chain protein structure prediction server
Rozbesky
Rozbesky
Rozbeský
Rozbeský
Ruotolo
Ruotolo
Salbo
Shen
Shevchenko
Sievers
Sovová
The Rosetta Software RosettaCommons
Tian
Valéria Grobárová
Villard
Vivier
Voigt
Vojtěch Spiwok
Václav Mareška
Williams
Winger
Young
Zal
Zdeněk Kukačka
Zelensky
Zelensky
Zemla
Zhang
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
In silico drug discovery for a complex immunotherapeutic target - human c-Rel protein
Author
Andrade
Bahadur
+81 more
Bahar
Bauer
Ben Nasr
Berkowitz
Campbell
Cao
ChemmineR
Chen
Chen
Chen
Choudhury
de Souza Neto
Drug Discovery
Edgar
Fauman
Finan
Fulford
Fuller
Gangadharan
Gilmore
Greenwell
Grinberg-Bleyer
Grinberg-Bleyer
Guo
Halgren
Hayden
Hayden
Hinsen
Hoffmann
Hoffmann
Hopkins
Hunter
Huxford
Hörberg
Jain
Jaleel
Jamkhande
Kanapeckaitė
Kelley
Kinghorn
Knapp
Kyte
Köntgen
Lavecchia
Lavecchia
Li
Li
Lionta
Macalino
Mandlik
Miraghazadeh
Molecular Dynamics Simulations - Gromacs
Müller
Müller
Needleman
Nooren
Pang
Peach
Phelps
Planesas
PubChem
RCSB PDB
Reynolds
Romanowska
RStudio
Ruan
Schmidtke
Shono
Singh
Skjaerven
Sliwoski
Sterling
Sterling
Ting
Tramontano
Trott
UCSF
Wako
Wang
Wells
Yu
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Molecular dynamics simulations in reservoir analysis of offshore petroleum reserves: A systematic review of theory and applications
Author
Allen
Allen
+92 more
Atoms In Motion LLC
Bao
Bondor
Boţan
Boţan
Brooks
Campos
Chakrabarti
Chamkalani
Cuendet
deLara
Demichelis
Didar
Ebrahimi
Ebro
Feng
Firouzi
Galliero
Galliéro
Ghiasi
Gibbs
Goodyear
Gouth
Griebel
GROMACS
Haile
He
Herdes
Ippoliti
Israelachvili
Jang
Jayasekera
Jin
Jin
Kamari
Kamari
Kamari
Karayiannis
Karniadakis
Kazemi
Kunieda
Lauricella
Lennard-Jones
Liu
Liu
Lobanova
Makimura
Maldonado
Masoud Seyyedattar
Max Born Institute
Meller
Myers
Müller
Naeem
Nath
Papaioannou
Pathak
Raveendran
Roux
Roy
Sedghi
Shimada
Silcox
Skelton
Skelton
Sohrab Zendehboudi
Sondergeld
Springer
Stephen Butt
Stote
Stote
Stukan
Thomas
Travalloni
U.S. Energy Information Administration
Ungerer
Ungerer
Velasco
Verlet
Wang
Wang
Wei
Welch
Wikipedia
Wu
Wu
Xu
Yang
York
Zendehboudi
Zendehboudi
Zendehboudi
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
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